SCHEMBL7930868

SCHEMBL7930868

CC(C)(C1=CC=CC1)c1c(-c2ccccc2)ccc2c1Cc1cc(-c3ccccc3)ccc1-2.[Zr]

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TDP2 O95551 2/20 0.36
TYRO3 Q06418 1/20 0.32
NTRK2 Q16620 1/20 0.32
CLK4 Q9HAZ1 1/20 0.32
DYRK1B Q9Y463 1/20 0.32
PARP10 Q53GL7 1/20 0.30
PARP11 Q9NR21 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL7939587 0.97 TDP2 (0.35) TDP2TYRO3NTRK2CLK4DYRK1B
SCHEMBL7942440 0.86 TDP2 (0.34) TDP2TYRO3NTRK2CLK4DYRK1B
Hydrochloric Acid SCHEMBL6559563 0.85 TDP2 (0.34) TDP2
Hydrochloric Acid SCHEMBL6559566 0.83 TDP2 (0.34) TDP2TYRO3NTRK2CLK4DYRK1B
SCHEMBL7940041 0.79
Hydrochloric Acid SCHEMBL7940037 0.76
SCHEMBL28733066 0.75 MPL (0.30)
Hydrochloric Acid SCHEMBL9229950 0.73 PGR (0.35) TDP2
Hydrochloric Acid SCHEMBL9231711 0.73 HSP90AA1 (0.36)
Hydrochloric Acid SCHEMBL9171682 0.72 TDP2 (0.36) TDP2PARP10PARP11

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0666267-B1 Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM CO (US) 2001-04-18 EP claimed